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17289-19-9 | Methyl 1-methyl-1H-imidazole-4-carboxylate
CAS No: 17289-19-9 Catalog No: AG0037ZG MDL No:MFCD02179561
Product Description
Catalog Number:
AG0037ZG
Chemical Name:
Methyl 1-methyl-1H-imidazole-4-carboxylate
CAS Number:
17289-19-9
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD02179561
IUPAC Name:
methyl 1-methylimidazole-4-carboxylate
InChI:
InChI=1S/C6H8N2O2/c1-8-3-5(7-4-8)6(9)10-2/h3-4H,1-2H3
InChI Key:
KZPZTVKOJSKVBV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncn(c1)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.142g/mol
Monoisotopic Mass:
140.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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